SCHEMBL18503901

SCHEMBL18503901

CC1(C)[C@@H]2CC[C@@H](C2)[C@@H]1CO

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ALOX15 P16050 1/20 0.33
GBA1 P04062 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6142600 1.00 ALDH1A1 (0.47) ALDH1A1NPSR1ALOX15GBA1
SCHEMBL10785695 0.83 ALDH1A1 (0.45) ALDH1A1NPSR1
SCHEMBL14721175 0.80 ALDH1A1 (0.45) ALDH1A1NPSR1
SCHEMBL23817169 0.78 ALDH1A1 (0.47) ALDH1A1NPSR1
SCHEMBL11605166 0.78 ALDH1A1 (0.48) ALDH1A1NPSR1
SCHEMBL10784662 0.77 ALDH1A1 (0.43) ALDH1A1NPSR1
SCHEMBL7925194 0.77 ALDH1A1 (0.43) ALDH1A1NPSR1
SCHEMBL11466774 0.77 ALDH1A1 (0.43) ALDH1A1NPSR1
SCHEMBL11601915 0.76 ALDH1A1 (0.43) ALDH1A1NPSR1
SCHEMBL10787814 0.76 ALDH1A1 (0.43) ALDH1A1NPSR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170044282-A1 TERPENE AND TERPENOID DERIVATIVES CONTAINING VINYL GROUPS FOR THE PREPARATION OF POLYMERS THE UNIVERSITY OF NOTTINGHAM (GB) 2017-02-16 US disclosed
US-20170044282-A1 TERPENE AND TERPENOID DERIVATIVES CONTAINING VINYL GROUPS FOR THE PREPARATION OF POLYMERS THE UNIVERSITY OF NOTTINGHAM (GB) 2017-02-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170044282-A1 TERPENE AND TERPENOID DERIVATIVES CONTAINING VINYL GROUPS FOR THE PREPARATION OF POLYMERS GGPS1, DHPS, FDPS ALDH1A1 966/4885NPSR1 4305/4885ALOX15 52/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.